3-[(5-bromanylthiophen-2-yl)carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 3-[(5-bromanylthiophen-2-yl)carbonylamino]-3-phenyl-propanoic acid Openeye Name: 3-[(5-bromothiophene-2-carbonyl)amino]-3-phenyl-propanoic acid CAS Name: 3-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-[(5-bromothiophene-2-carbonyl)amino]-3-phenylpropanoic acid Traditional Name: 3-[(5-bromothiophene-2-carbonyl)amino]-3-phenyl-propionic acid Formula: C14H12BrNO3S MolecularWeight: 354.21898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC=C(S2)Br

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C14H12BrNO3S/c15-12-7-6-11(20-12)14(19)16-10(8-13(17)18)9-4-2-1-3-5-9/h1-7,10H,8H2,(H,16,19)(H,17,18)